SCHEMBL9788005

SCHEMBL9788005

CCCCCCCCCCCCCC1=NC(C)(C)CO1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPL P06858 4/20 0.33
LIPG Q9Y5X9 4/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
THRB P10828 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL474113 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL9787852 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL10619634 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL10616726 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL9787882 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL10491866 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL9787850 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL10491816 1.00 LPL (0.33) LPLLIPGKCNH2KDM4EPDE3B
SCHEMBL9787963 0.98 KDM4E (0.34) LPLLIPGKCNH2KDM4E
SCHEMBL5796273 0.92 KDM4E (0.35) KDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5030629-A Transdermal Administration Of Cardiovascular Agents THERAPEUTIC PATCH RESEARCH N.V. 1991-07-09 US disclosed
US-4876249-A TOPICAL; TRANSDERMAL, SYSTEMIC; FLUOCINOLINE ACETONIDE AND IMIDAZOLINE OR OXAZOLINE PENETRATION ENHANCER MIXTURE; THERAPEUTIC DRUGS THERAPEUTIC PATCH RESEARCH N.V. 1989-10-24 US disclosed